2,3,6,7-Tetrahydro-4-methyl-2-[(1E)-3-methyl-1,3-butadien-1-yl]oxepin

CAS Registry Number®

132925-10-1

CAS Name

2,3,6,7-Tetrahydro-4-methyl-2-[(1E)-3-methyl-1,3-butadien-1-yl]oxepin

Molecular Formula

C12H18O

Molecular Mass

178.27

Cite this Page

2,3,6,7-Tetrahydro-4-methyl-2-[(1E)-3-methyl-1,3-butadien-1-yl]oxepin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=132925-10-1 (retrieved 2024-11-25) (CAS RN: 132925-10-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    110-120 °C @ Press: 11 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1/C12H18O/c1-10(2)6-7-12-9-11(3)5-4-8-13-12/h5-7,12H,1,4,8-9H2,2-3H3/b7-6+

InChIKey

InChIKey=JEUOOEBZKFVZGG-VOTSOKGWNA-N

SMILES

C(=C/C(C)=C)\C1CC(C)=CCCO1

Canonical SMILES

O1CCC=C(C)CC1C=CC(=C)C

Other Names for this Substance

  • Oxepin, 2,3,6,7-tetrahydro-4-methyl-2-[(1E)-3-methyl-1,3-butadien-1-yl]-
  • Oxepin, 2,3,6,7-tetrahydro-4-methyl-2-(3-methyl-1,3-butadienyl)-, (E)-(±)-
  • Oxepin, 2,3,6,7-tetrahydro-4-methyl-2-(3-methyl-1,3-butadienyl)-, (E)-
  • 2,3,6,7-Tetrahydro-4-methyl-2-[(1E)-3-methyl-1,3-butadien-1-yl]oxepin

Deleted or Replaced CAS Registry Numbers

168831-09-2

CAS INSIGHTSTM
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